CID 3033992

765-12-8

Structural Information

Molecular Formula

C₁₀H₁₈O₄

SMILES

C=COCCOCCOCCOC=C

InChI

InChI=1S/C10H18O4/c1-3-11-5-7-13-9-10-14-8-6-12-4-2/h3-4H,1-2,5-10H2

InChIKey

CYIGRWUIQAVBFG-UHFFFAOYSA-N

Compound name

1,2-bis(2-ethenoxyethoxy)ethane

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 24318
Patents: 202.12051 Da
Monoisotopic Mass: 1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	203.127786	145.3
[M+Na]+	225.109728	151.4
[M-H]-	201.113234	144.8
[M+NH4]+	220.154333	164.5
[M+K]+	241.083668	150.8
[M+H-H2O]+	185.117770	139.7
[M+HCOO]-	247.118711	169.2
[M+CH3COO]-	261.134361	185.4
[M+Na-2H]-	223.095176	150.5
[M]+	202.11996142	152.7
[M]-	202.12105858	152.7

Literature stripe

literature stripe

Patent stripe

patents stripe